OPTIMIZED GEOMETRIES OF SADDLE-POINT ROTAMERS OF FORMAMIDE

被引:37
作者
NALEWAJSKI, RF [1 ]
机构
[1] UNIV N CAROLINA,DEPT CHEM,CHAPEL HILL,NC 27514
关键词
D O I
10.1021/ja00469a007
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
引用
收藏
页码:41 / 46
页数:6
相关论文
共 58 条
[1]   ABINITIO STUDY OF AMIDIC BOND-CLEAVAGE BY OH- IN FORMAMIDE [J].
ALAGONA, G ;
SCROCCO, E ;
TOMASI, J .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1975, 97 (24) :6976-6983
[2]   EFFECT OF CATION BINDING ON ROTATION BARRIER OF PEPTIDE-BOND [J].
ARMBRUSTER, AM ;
PULLMAN, A .
FEBS LETTERS, 1974, 49 (01) :18-21
[3]   ELECTRONIC SPECTRA OF ISOELECTRONIC AMIDES ACIDS AND ACYL FLUORIDES [J].
BASCH, H ;
ROBIN, MB ;
KUEBLER, NA .
JOURNAL OF CHEMICAL PHYSICS, 1968, 49 (11) :5007-&
[4]   ELECTRONIC STATES OF AMIDE GROUP [J].
BASCH, H ;
ROBIN, MB ;
KUEBLER, NA .
JOURNAL OF CHEMICAL PHYSICS, 1967, 47 (04) :1201-&
[5]   GROUND-STATES OF MOLECULES .25. MINDO-3 - IMPROVED VERSION OF MINDO SEMIEMPIRICAL SCF-MO METHOD [J].
BINGHAM, RC ;
DEWAR, MJS ;
LO, DH .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1975, 97 (06) :1285-1293
[6]   N- VERSUS O-PROTON AFFINITIES OF AMIDE GROUP - AB-INITIO ELECTROSTATIC MOLECULAR POTENTIALS [J].
BONACCORSI, R ;
TOMASI, J ;
SCROCCO, E ;
PULLMAN, A .
CHEMICAL PHYSICS LETTERS, 1972, 12 (04) :622-+
[7]   RESULTS OF AB-INITIO CALCULATIONS ON FORMAMIDE [J].
CHRISTENSEN, DH ;
KORTZEBORN, RN ;
BAK, B ;
LED, JJ .
JOURNAL OF CHEMICAL PHYSICS, 1970, 53 (10) :3912-3922
[8]  
CHRISTOFFERSEN RE, 1973, J AM CHEM SOC, V95, P8526, DOI 10.1021/ja00807a005
[9]  
COSTAIN CC, 1957, J CHEM PHYS, V27, P585
[10]  
DAUDEY JP, 1974, FEBS LETT, V49, P18